5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine

C18H28N2 — CID 64932001

IUPAC5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine
SMILESCCC1CNC(C)(C2CC2)CN1C(C)c1ccccc1
InChIInChI=1S/C18H28N2/c1-4-17-12-19-18(3,16-10-11-16)13-20(17)14(2)15-8-6-5-7-9-15/h5-9,14,16-17,19H,4,10-13H2,1-3H3
InChIKeyPELJCCAJPYGUTL-UHFFFAOYSA-N
MW272.44 g/mol
LogP3.60
Rot. Bonds4

About 5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine

5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine (PubChem CID 64932001) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is 5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine.

Molecular Properties

Compound Name5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine
PubChem CID64932001
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC Name5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine
SMILESCCC1CNC(C)(C2CC2)CN1C(C)c1ccccc1
InChIInChI=1S/C18H28N2/c1-4-17-12-19-18(3,16-10-11-16)13-20(17)14(2)15-8-6-5-7-9-15/h5-9,14,16-17,19H,4,10-13H2,1-3H3
InChIKeyPELJCCAJPYGUTL-UHFFFAOYSA-N
XLogP3.60
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-4-ylethyl)piperazine
CID 64935896
5-cyclopropyl-2-ethyl-5-methyl-1-(1-pyridin-3-ylethyl)piperazine
CID 64934546
5-cyclopropyl-2-ethyl-5-methyl-1-octan-2-ylpiperazine
CID 64948368
1-[1-(4-chlorophenyl)ethyl]-2-ethyl-5,5-dimethylpiperazine
CID 64948195
5-cyclopropyl-1-[1-(2-fluorophenyl)ethyl]-2,5-dimethylpiperazine
CID 64945697
1-[1-(3-chlorophenyl)ethyl]-2,5-diethyl-5-methylpiperazine
CID 64945691
5-cyclopropyl-2,5-dimethyl-1-propan-2-ylpiperazine
CID 64875943
5-cyclopropyl-2,5-dimethyl-1-(1-thiophen-2-ylethyl)piperazine
CID 64933400
5-cyclopropyl-2-ethyl-5-methyl-1-(2-propylphenyl)piperazine
CID 64945723
1-(1-cyclopropylpropan-2-yl)-2-ethyl-5-methyl-5-phenylpiperazine
CID 64941635
2,5-diethyl-5-methyl-1-(1-phenylpropan-2-yl)piperazine
CID 64941765
2-ethyl-5,5-dimethyl-1-(1-pyridin-2-ylethyl)piperazine
CID 64935510

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine?
The IUPAC name of 5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine (CID 64932001) is 5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine.
What is the SMILES notation for 5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine?
The canonical SMILES for 5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine is CCC1CNC(C)(C2CC2)CN1C(C)c1ccccc1.
What is the InChIKey of 5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine?
The InChIKey is PELJCCAJPYGUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-4-17-12-19-18(3,16-10-11-16)13-20(17)14(2)15-8-6-5-7-9-15/h5-9,14,16-17,19H,4,10-13H2,1-3H3.
What are the key properties of 5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine?
5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine has a molecular weight of 272.44 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-ethyl-5-methyl-1-(1-phenylethyl)piperazine is sourced from PubChem (CID 64932001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).